N2-(5-chloranyl-2-methyl-phenyl)-N4-(4-methoxyphenyl)pteridine-2,4-diamine

Systemtic Name: N2-(5-chloranyl-2-methyl-phenyl)-N4-(4-methoxyphenyl)pteridine-2,4-diamine Openeye Name: N2-(5-chloro-2-methyl-phenyl)-N4-(4-methoxyphenyl)pteridine-2,4-diamine CAS Name: N2-(5-chloro-2-methylphenyl)-N4-(4-methoxyphenyl)pteridine-2,4-diamine IUPAC Name: 2-N-(5-chloro-2-methylphenyl)-4-N-(4-methoxyphenyl)pteridine-2,4-diamine Traditional Name: [2-(5-chloro-2-methyl-anilino)pteridin-4-yl]-(4-methoxyphenyl)amine Formula: C20H17ClN6O MolecularWeight: 392.84158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC2=NC3=NC=CN=C3C(=N2)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC2=NC3=NC=CN=C3C(=N2)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H17ClN6O/c1-12-3-4-13(21)11-16(12)25-20-26-18-17(22-9-10-23-18)19(27-20)24-14-5-7-15(28-2)8-6-14/h3-11H,1-2H3,(H2,23,24,25,26,27)